[2,4-dimethoxy-6-[2-(4-methoxyphenyl)ethenyl]phenyl]-(3,5-dimethoxyphenyl)methanol

C26H28O6 — CID 90702066

IUPAC[2,4-dimethoxy-6-[2-(4-methoxyphenyl)ethenyl]phenyl]-(3,5-dimethoxyphenyl)methanol
SMILESCOc1ccc(C=Cc2cc(OC)cc(OC)c2C(O)c2cc(OC)cc(OC)c2)cc1
InChIInChI=1S/C26H28O6/c1-28-20-10-7-17(8-11-20)6-9-18-12-23(31-4)16-24(32-5)25(18)26(27)19-13-21(29-2)15-22(14-19)30-3/h6-16,26-27H,1-5H3
InChIKeyYIWJSAJNDWAXJQ-UHFFFAOYSA-N
MW436.50 g/mol
LogP4.98
Rot. Bonds9

About [2,4-dimethoxy-6-[2-(4-methoxyphenyl)ethenyl]phenyl]-(3,5-dimethoxyphenyl)methanol

[2,4-dimethoxy-6-[2-(4-methoxyphenyl)ethenyl]phenyl]-(3,5-dimethoxyphenyl)methanol (PubChem CID 90702066) has the molecular formula C26H28O6 and a molecular weight of 436.50 g/mol. Its IUPAC name is [2,4-dimethoxy-6-[2-(4-methoxyphenyl)ethenyl]phenyl]-(3,5-dimethoxyphenyl)methanol.

Molecular Properties

Compound Name[2,4-dimethoxy-6-[2-(4-methoxyphenyl)ethenyl]phenyl]-(3,5-dimethoxyphenyl)methanol
PubChem CID90702066
Molecular FormulaC26H28O6
Molecular Weight436.50 g/mol
Exact Mass436.19
IUPAC Name[2,4-dimethoxy-6-[2-(4-methoxyphenyl)ethenyl]phenyl]-(3,5-dimethoxyphenyl)methanol
SMILESCOc1ccc(C=Cc2cc(OC)cc(OC)c2C(O)c2cc(OC)cc(OC)c2)cc1
InChIInChI=1S/C26H28O6/c1-28-20-10-7-17(8-11-20)6-9-18-12-23(31-4)16-24(32-5)25(18)26(27)19-13-21(29-2)15-22(14-19)30-3/h6-16,26-27H,1-5H3
InChIKeyYIWJSAJNDWAXJQ-UHFFFAOYSA-N
XLogP4.98
TPSA66.38 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds9
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500436.50
LogP ≤ 54.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'stilbene', 'substructure': 'N/A'}

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Related Compounds

[3-[(3,5-dimethoxyphenyl)-hydroxymethyl]-4,6-dimethoxy-2-[(E)-2-(4-methoxyphenyl)ethenyl]phenyl]-(3-methoxy-5-methylphenyl)methanol
CID 89026769
2-bromo-1,5-dimethoxy-3-[2-(4-methoxyphenyl)ethenyl]benzene
CID 68729529
4-[2-[2-[2-(3,5-dimethoxyphenyl)-1-(4-hydroxyphenyl)ethyl]-3,5-dimethoxyphenyl]ethenyl]phenol
CID 162879563
2-[(E)-1,3-bis(4-methoxyphenyl)prop-2-enyl]-1,3,5-trimethoxybenzene
CID 169227072
2-[(E)-1-(3,5-dimethoxyphenyl)-2-(4-methoxyphenyl)ethenyl]-1,5-dimethoxy-3-[(E)-2-(4-methoxyphenyl)ethenyl]benzene
CID 89202401
2-[1-(3,5-dimethoxyphenyl)-2-(4-methoxyphenyl)ethenyl]-1,5-dimethoxy-3-[2-(4-methoxyphenyl)ethenyl]benzene
CID 123758445
1,3-dimethoxy-5-[2-(4-methoxy(1,2,3,4,5,6-13C6)cyclohexa-1,3,5-trien-1-yl)ethenyl]benzene
CID 57369399
1-[(Z)-2-(2,4-dimethoxyphenyl)ethenyl]-3,5-dimethoxybenzene
CID 6604874
1-methoxy-4-[2-[4-[2-[4-[2-(4-methoxyphenyl)ethenyl]phenyl]ethenyl]phenyl]ethenyl]benzene
CID 76573307
2-[3-(4-hydroxy-2-methoxyphenyl)-1-(4-methoxyphenyl)propyl]-3-[2-(4-hydroxyphenyl)ethenyl]-5-methoxyphenol
CID 74080754
2-[[4-[2-(3,5-dimethoxyphenyl)ethenyl]phenyl]-hydroxymethyl]phenol
CID 123691601
1-[(E)-2-(4-chlorophenyl)ethenyl]-3,5-dimethoxy-2-[(4-methoxyphenyl)methyl]benzene
CID 175647412

Frequently Asked Questions

What is the IUPAC name of [2,4-dimethoxy-6-[2-(4-methoxyphenyl)ethenyl]phenyl]-(3,5-dimethoxyphenyl)methanol?
The IUPAC name of [2,4-dimethoxy-6-[2-(4-methoxyphenyl)ethenyl]phenyl]-(3,5-dimethoxyphenyl)methanol (CID 90702066) is [2,4-dimethoxy-6-[2-(4-methoxyphenyl)ethenyl]phenyl]-(3,5-dimethoxyphenyl)methanol.
What is the SMILES notation for [2,4-dimethoxy-6-[2-(4-methoxyphenyl)ethenyl]phenyl]-(3,5-dimethoxyphenyl)methanol?
The canonical SMILES for [2,4-dimethoxy-6-[2-(4-methoxyphenyl)ethenyl]phenyl]-(3,5-dimethoxyphenyl)methanol is COc1ccc(C=Cc2cc(OC)cc(OC)c2C(O)c2cc(OC)cc(OC)c2)cc1.
What is the InChIKey of [2,4-dimethoxy-6-[2-(4-methoxyphenyl)ethenyl]phenyl]-(3,5-dimethoxyphenyl)methanol?
The InChIKey is YIWJSAJNDWAXJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H28O6/c1-28-20-10-7-17(8-11-20)6-9-18-12-23(31-4)16-24(32-5)25(18)26(27)19-13-21(29-2)15-22(14-19)30-3/h6-16,26-27H,1-5H3.
What are the key properties of [2,4-dimethoxy-6-[2-(4-methoxyphenyl)ethenyl]phenyl]-(3,5-dimethoxyphenyl)methanol?
[2,4-dimethoxy-6-[2-(4-methoxyphenyl)ethenyl]phenyl]-(3,5-dimethoxyphenyl)methanol has a molecular weight of 436.50 g/mol, XLogP of 4.98, 9 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [2,4-dimethoxy-6-[2-(4-methoxyphenyl)ethenyl]phenyl]-(3,5-dimethoxyphenyl)methanol is sourced from PubChem (CID 90702066), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).